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N-benzyl-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID A09Pu0Cesn3
InChI InChI=1S/C22H19N5OS/c28-20(24-15-17-7-3-1-4-8-17)16-29-22-26-25-21(18-11-13-23-14-12-18)27(22)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,24,28)
InChIKey KVBJQZCCPKKWFB-UHFFFAOYSA-N
Mol Weight 401.49 g/mol
Molecular Formula C22H19N5OS
Exact Mass 401.131031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KBZSG6ojox1
Name N-benzyl-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.131031425 u
Formula C22H19N5OS
InChI InChI=1S/C22H19N5OS/c28-20(24-15-17-7-3-1-4-8-17)16-29-22-26-25-21(18-11-13-23-14-12-18)27(22)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,24,28)
InChIKey KVBJQZCCPKKWFB-UHFFFAOYSA-N
Molecular Weight 401.488 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1240
Solvent DMSO-d6
Source Vendor ID: NMR/12269397